2-[(4-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide

Systemtic Name: 2-[(4-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]ethanamide Openeye Name: 2-[4-ethyl-N-(p-tolylsulfonyl)anilino]-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide CAS Name: 2-(4-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide IUPAC Name: 2-(4-ethyl-N-(4-methylphenyl)sulfonylanilino)-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]acetamide Traditional Name: 2-(4-ethyl-N-tosyl-anilino)-N-[2-methyl-4-[(phenylthio)methyl]phenyl]acetamide Formula: C31H32N2O3S2 MolecularWeight: 544.72738

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NC2=C(C=C(C=C2)CSC3=CC=CC=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NC2=C(C=C(C=C2)CSC3=CC=CC=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C31H32N2O3S2/c1-4-25-12-15-27(16-13-25)33(38(35,36)29-17-10-23(2)11-18-29)21-31(34)32-30-19-14-26(20-24(30)3)22-37-28-8-6-5-7-9-28/h5-20H,4,21-22H2,1-3H3,(H,32,34)